REMARK  Name = BDB064007
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -0.640  -2.788   2.252  0.00  0.00    -0.268 OA
ATOM      2  C   LIG    1       -0.741  -1.909   1.421  0.00  0.00    +0.269 C 
ATOM      3  C   LIG    1        0.329  -1.103   0.774  0.00  0.00    +0.130 C 
ATOM      4  C   LIG    1        1.621  -1.260   1.091  0.00  0.00    +0.041 C 
ATOM      5  N   LIG    1       -0.233  -0.260  -0.160  0.00  0.00    -0.213 NA
ATOM      6  C   LIG    1       -1.513  -0.487  -0.086  0.00  0.00    +0.192 C 
ATOM      7  N   LIG    1       -1.862  -1.429   0.825  0.00  0.00    -0.253 N 
ATOM      8  H   LIG    1       -2.777  -1.819   0.974  0.00  0.00    +0.158 HD
ENDROOT
BRANCH   4   9
ATOM      9  C   LIG    1        2.760  -0.538   0.503  0.00  0.00    -0.022 A 
ATOM     10  C   LIG    1        3.967  -1.235   0.327  0.00  0.00    +0.025 A 
ATOM     11  C   LIG    1        5.076  -0.552  -0.204  0.00  0.00    +0.039 A 
ATOM     12  C   LIG    1        5.016   0.800  -0.548  0.00  0.00    +0.078 A 
ATOM     13  N   LIG    1        6.187   1.338  -1.058  0.00  0.00    -0.247 NA
ATOM     14  C   LIG    1        7.113   0.407  -1.098  0.00  0.00    +0.157 A 
ATOM     15  C   LIG    1        3.807   1.492  -0.350  0.00  0.00    +0.029 A 
ATOM     16  S   LIG    1        6.659  -1.146  -0.539  0.00  0.00    -0.075 S 
ATOM     17  C   LIG    1        2.696   0.820   0.177  0.00  0.00    +0.010 A 
ENDBRANCH   4   9
BRANCH   6  18
ATOM     18  N   LIG    1       -2.421   0.129  -0.888  0.00  0.00    -0.286 N 
ATOM     19  H   LIG    1       -1.994   0.720  -1.595  0.00  0.00    +0.155 HD
BRANCH  18  20
ATOM     20  C   LIG    1       -3.746   0.489  -0.595  0.00  0.00    +0.052 A 
ATOM     21  C   LIG    1       -4.304   0.502   0.683  0.00  0.00    +0.134 A 
ATOM     22  N   LIG    1       -5.600   0.792   0.960  0.00  0.00    -0.261 NA
ATOM     23  C   LIG    1       -6.392   1.093  -0.089  0.00  0.00    +0.111 A 
ATOM     24  C   LIG    1       -5.948   1.115  -1.398  0.00  0.00    +0.021 A 
ATOM     25  C   LIG    1       -4.611   0.804  -1.648  0.00  0.00    +0.026 A 
ENDBRANCH  18  20
ENDBRANCH   6  18
TORSDOF 3